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2-Bromo-3-pyridinamine

CAT: 0013-GTR19246162-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19246162-01Size:25 g
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Description
2-Bromo-3-pyridinamine is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
39856-58-1
Smiles
NC1=CC=CN=C1Br
Molecular Formula
C5H5BrN2
Molecular Weight
173.011
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-Amino-2-bromopyridine
CAS Number39856-58-1
PubChem CID642816
IUPAC Name2-bromopyridin-3-amine
Molecular FormulaC5H5BrN2
Molecular Weight173.01
XLogP1.2
Topological Polar Surface Area38.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity76
SMILES
C1=CC(=C(N=C1)Br)N
InChI
InChI=1S/C5H5BrN2/c6-5-4(7)2-1-3-8-5/h1-3H,7H2
InChIKey
HKDVVTLISGIPFE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Amino-2-bromopyridine
CAS: 39856-58-1
CID: 642816
Formula: C5H5BrN2
MW: 173.01
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight173.01
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass171.96361
Monoisotopic Mass171.96361
Topological Polar Surface Area38.9 Ų
Heavy Atom Count8
Formal Charge0
Complexity76.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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